6-chloranyl-N-heptan-4-yl-1,3-benzodioxol-5-amine

Systemtic Name: 6-chloranyl-N-heptan-4-yl-1,3-benzodioxol-5-amine Openeye Name: 6-chloro-N-(1-propylbutyl)-1,3-benzodioxol-5-amine CAS Name: 6-chloro-N-heptan-4-yl-1,3-benzodioxol-5-amine IUPAC Name: 6-chloro-N-heptan-4-yl-1,3-benzodioxol-5-amine Traditional Name: (6-chloro-1,3-benzodioxol-5-yl)-(1-propylbutyl)amine Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC2=C(C=C1Cl)OCO2

Isomeric SMILES

CCCC(CCC)NC1=CC2=C(C=C1Cl)OCO2

InChI

InChI=1S/C14H20ClNO2/c1-3-5-10(6-4-2)16-12-8-14-13(7-11(12)15)17-9-18-14/h7-8,10,16H,3-6,9H2,1-2H3